4-formyl phenyl butyrate
butanoic acid, 4-formylphenyl ester
 
Notes:
None found
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CAS Number: 50262-49-2Picture of molecule3D/inchi
Nikkaji Web: J422.518J
MDL: MFCD00021058
XlogP3-AA: 2.00 (est)
Molecular Weight: 192.21424000
Formula: C11 H12 O3
NMR Predictor: Predict (works with chrome or firefox)
Category: information only not used for fragrances or flavors
 
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Physical Properties:
Appearance: colorless to pale yellow solid (est)
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Boiling Point: 304.00 to  305.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure: 0.001000 mmHg @ 25.00 °C. (est)
Flash Point: 271.00 °F. TCC ( 132.80 °C. ) (est)
logP (o/w): 2.284 (est)
Soluble in:
 alcohol
 water, 531.5 mg/L 2 25 °C (est)
Insoluble in:
 water
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Organoleptic Properties:
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
Frinton Laboratories
For experimental / research use only.
4-Formylphenyl Butyrate
Sigma-Aldrich: Aldrich
For experimental / research use only.
4-formylphenyl butyrate
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Safety Information:
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
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Safety in Use Information:
Category: information only not used for fragrances or flavors
Recommendation for 4-formyl phenyl butyrate usage levels up to:
 not for fragrance use.
 
Recommendation for 4-formyl phenyl butyrate flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
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Cancer Citations: Search
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EPA Substance Registry Services (TSCA): 50262-49-2
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 123520
National Institute of Allergy and Infectious Diseases: Data
 (4-formylphenyl) butanoate
Chemidplus: 0050262492
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References:
 (4-formylphenyl) butanoate
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 123520
Pubchem (sid): 135079881
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Other Information:
(IUPAC): Atomic Weights of the Elements 2011 (pdf)
Videos: The Periodic Table of Videos
tgsc: Atomic Weights use for this web site
(IUPAC): Periodic Table of the Elements
HMDB (The Human Metabolome Database): Search
ChemSpider: View
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Potential Blenders and core components note
 
None Found
 
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Potential Uses:
None Found
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Occurrence (nature, food, other): note
 not found in nature
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Synonyms:
 butanoic acid 4-formylphenyl ester
 butanoic acid, 4-formylphenyl ester
4-butyryloxybenzaldehyde
p-butyryloxybenzaldehyde
para-butyryloxybenzaldehyde
4-formylphenyl butanoate
4-formylphenyl butyrate
p-formylphenyl butyrate
(4-formylphenyl) butanoate
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